2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol

C16H16Cl2O — CID 106868133

IUPAC2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol
SMILESCc1ccc(CC(O)c2cc(Cl)ccc2C)c(Cl)c1
InChIInChI=1S/C16H16Cl2O/c1-10-3-5-12(15(18)7-10)8-16(19)14-9-13(17)6-4-11(14)2/h3-7,9,16,19H,8H2,1-2H3
InChIKeyVHMVYSALAJQCJI-UHFFFAOYSA-N
MW295.21 g/mol
LogP4.89
Rot. Bonds3

About 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol

2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol (PubChem CID 106868133) has the molecular formula C16H16Cl2O and a molecular weight of 295.21 g/mol. Its IUPAC name is 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol
PubChem CID106868133
Molecular FormulaC16H16Cl2O
Molecular Weight295.21 g/mol
Exact Mass294.06
IUPAC Name2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol
SMILESCc1ccc(CC(O)c2cc(Cl)ccc2C)c(Cl)c1
InChIInChI=1S/C16H16Cl2O/c1-10-3-5-12(15(18)7-10)8-16(19)14-9-13(17)6-4-11(14)2/h3-7,9,16,19H,8H2,1-2H3
InChIKeyVHMVYSALAJQCJI-UHFFFAOYSA-N
XLogP4.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chloro-4-methylphenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 106867292
2-(2,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607142
1,2-bis(2-chloro-4-methylphenyl)ethanol
CID 106868189
2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanamine
CID 106866367
1-(2-chloro-4-methylphenyl)-3-(2,4-dichlorophenyl)propan-2-ol
CID 106867255
1-(5-chloro-2-fluorophenyl)-2-(2,5-dimethylphenyl)ethanol
CID 55149164
1-(5-bromo-2-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethanol
CID 106866248
2-(2-chloro-4-methylphenyl)-1-(2,3-dimethylphenyl)ethanol
CID 106866259
2-(2-chloro-4-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607143
2-(2-chloro-4-methylphenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 106866233
1-(2-aminophenyl)-2-(2-chloro-4-methylphenyl)ethanol
CID 106867344
2-(2-bromo-4-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115787001

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol?
The IUPAC name of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol (CID 106868133) is 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol.
What is the SMILES notation for 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol?
The canonical SMILES for 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol is Cc1ccc(CC(O)c2cc(Cl)ccc2C)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol?
The InChIKey is VHMVYSALAJQCJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2O/c1-10-3-5-12(15(18)7-10)8-16(19)14-9-13(17)6-4-11(14)2/h3-7,9,16,19H,8H2,1-2H3.
What are the key properties of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol?
2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol has a molecular weight of 295.21 g/mol, XLogP of 4.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol is sourced from PubChem (CID 106868133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).